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PubMed code 22341895

Compile data set for download or QSAR
Found 26 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM21015
PNG
((2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl...)
Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCO
Show InChI InChI=1S/C26H35N5O6/c1-17(30-25(36)21(27)14-19-8-10-20(33)11-9-19)24(35)29-16-23(34)31(2)22(26(37)28-12-13-32)15-18-6-4-3-5-7-18/h3-11,17,21-22,32-33H,12-16,27H2,1-2H3,(H,28,37)(H,29,35)(H,30,36)/t17-,21+,22+/m1/s1
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1.20n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from human mu opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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2.60n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from human mu opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50381677
PNG
(CHEMBL1256748 | U-69593)
Show SMILES CN([C@H]1C[C@@]2(CCCO2)CC[C@@H]1N1CCCC1)C(=O)Cc1ccccc1 |r|
Show InChI InChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)20-17-22(11-7-15-26-22)12-10-19(20)24-13-5-6-14-24/h2-4,8-9,19-20H,5-7,10-17H2,1H3/t19-,20-,22+/m0/s1
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3.5n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-U69593 from human kappa opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50365111
PNG
(CHEMBL1951702)
Show SMILES O[C@@H]1CN(CCc2ccccc2)[C@H]2CCC[C@@]1(C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C22H27NO2/c24-20-10-4-8-18(14-20)22-12-5-9-19(15-22)23(16-21(22)25)13-11-17-6-2-1-3-7-17/h1-4,6-8,10,14,19,21,24-25H,5,9,11-13,15-16H2/t19-,21+,22+/m0/s1
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4.60n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from human mu opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50365113
PNG
(CHEMBL1951705)
Show SMILES CN1CC2(OCCO2)[C@@]2(CCC[C@H]1C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C17H23NO3/c1-18-12-17(20-8-9-21-17)16(7-3-5-14(18)11-16)13-4-2-6-15(19)10-13/h2,4,6,10,14,19H,3,5,7-9,11-12H2,1H3/t14-,16+/m0/s1
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22n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from human mu opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50365109
PNG
(CHEMBL1951701)
Show SMILES O[C@H]1CN(CCc2ccccc2)[C@H]2CCC[C@@]1(C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C22H27NO2/c24-20-10-4-8-18(14-20)22-12-5-9-19(15-22)23(16-21(22)25)13-11-17-6-2-1-3-7-17/h1-4,6-8,10,14,19,21,24-25H,5,9,11-13,15-16H2/t19-,21-,22+/m0/s1
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74n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from human mu opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50365108
PNG
(CHEMBL1951699)
Show SMILES CN1C[C@H](O)[C@@]2(CCC[C@H]1C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C15H21NO2/c1-16-10-14(18)15(7-3-5-12(16)9-15)11-4-2-6-13(17)8-11/h2,4,6,8,12,14,17-18H,3,5,7,9-10H2,1H3/t12-,14-,15+/m0/s1
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138n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from human mu opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50365113
PNG
(CHEMBL1951705)
Show SMILES CN1CC2(OCCO2)[C@@]2(CCC[C@H]1C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C17H23NO3/c1-18-12-17(20-8-9-21-17)16(7-3-5-14(18)11-16)13-4-2-6-15(19)10-13/h2,4,6,10,14,19H,3,5,7-9,11-12H2,1H3/t14-,16+/m0/s1
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140n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-U69593 from human kappa opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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299n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-U69593 from human kappa opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50365112
PNG
(CHEMBL1951704)
Show SMILES CN1C2C[C@](CCC2)([C@@H]1CO)c1cccc(O)c1 |r|
Show InChI InChI=1S/C15H21NO2/c1-16-12-5-3-7-15(9-12,14(16)10-17)11-4-2-6-13(18)8-11/h2,4,6,8,12,14,17-18H,3,5,7,9-10H2,1H3/t12?,14-,15-/m0/s1
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315n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from human mu opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50365110
PNG
(CHEMBL1951700)
Show SMILES CN1C[C@@H](O)[C@@]2(CCC[C@H]1C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C15H21NO2/c1-16-10-14(18)15(7-3-5-12(16)9-15)11-4-2-6-13(17)8-11/h2,4,6,8,12,14,17-18H,3,5,7,9-10H2,1H3/t12-,14+,15+/m0/s1
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346n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from human mu opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50365112
PNG
(CHEMBL1951704)
Show SMILES CN1C2C[C@](CCC2)([C@@H]1CO)c1cccc(O)c1 |r|
Show InChI InChI=1S/C15H21NO2/c1-16-12-5-3-7-15(9-12,14(16)10-17)11-4-2-6-13(18)8-11/h2,4,6,8,12,14,17-18H,3,5,7,9-10H2,1H3/t12?,14-,15-/m0/s1
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483n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-U69593 from human kappa opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50365111
PNG
(CHEMBL1951702)
Show SMILES O[C@@H]1CN(CCc2ccccc2)[C@H]2CCC[C@@]1(C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C22H27NO2/c24-20-10-4-8-18(14-20)22-12-5-9-19(15-22)23(16-21(22)25)13-11-17-6-2-1-3-7-17/h1-4,6-8,10,14,19,21,24-25H,5,9,11-13,15-16H2/t19-,21+,22+/m0/s1
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604n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-U69593 from human kappa opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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605n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DADLE from human delta opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50365109
PNG
(CHEMBL1951701)
Show SMILES O[C@H]1CN(CCc2ccccc2)[C@H]2CCC[C@@]1(C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C22H27NO2/c24-20-10-4-8-18(14-20)22-12-5-9-19(15-22)23(16-21(22)25)13-11-17-6-2-1-3-7-17/h1-4,6-8,10,14,19,21,24-25H,5,9,11-13,15-16H2/t19-,21-,22+/m0/s1
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751n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-U69593 from human kappa opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50365111
PNG
(CHEMBL1951702)
Show SMILES O[C@@H]1CN(CCc2ccccc2)[C@H]2CCC[C@@]1(C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C22H27NO2/c24-20-10-4-8-18(14-20)22-12-5-9-19(15-22)23(16-21(22)25)13-11-17-6-2-1-3-7-17/h1-4,6-8,10,14,19,21,24-25H,5,9,11-13,15-16H2/t19-,21+,22+/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DADLE from human delta opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM21015
PNG
((2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl...)
Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCO
Show InChI InChI=1S/C26H35N5O6/c1-17(30-25(36)21(27)14-19-8-10-20(33)11-9-19)24(35)29-16-23(34)31(2)22(26(37)28-12-13-32)15-18-6-4-3-5-7-18/h3-11,17,21-22,32-33H,12-16,27H2,1-2H3,(H,28,37)(H,29,35)(H,30,36)/t17-,21+,22+/m1/s1
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1.50E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DADLE from human delta opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50381677
PNG
(CHEMBL1256748 | U-69593)
Show SMILES CN([C@H]1C[C@@]2(CCCO2)CC[C@@H]1N1CCCC1)C(=O)Cc1ccccc1 |r|
Show InChI InChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)20-17-22(11-7-15-26-22)12-10-19(20)24-13-5-6-14-24/h2-4,8-9,19-20H,5-7,10-17H2,1H3/t19-,20-,22+/m0/s1
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2.37E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from human mu opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50365108
PNG
(CHEMBL1951699)
Show SMILES CN1C[C@H](O)[C@@]2(CCC[C@H]1C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C15H21NO2/c1-16-10-14(18)15(7-3-5-12(16)9-15)11-4-2-6-13(17)8-11/h2,4,6,8,12,14,17-18H,3,5,7,9-10H2,1H3/t12-,14-,15+/m0/s1
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3.80E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-U69593 from human kappa opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50365109
PNG
(CHEMBL1951701)
Show SMILES O[C@H]1CN(CCc2ccccc2)[C@H]2CCC[C@@]1(C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C22H27NO2/c24-20-10-4-8-18(14-20)22-12-5-9-19(15-22)23(16-21(22)25)13-11-17-6-2-1-3-7-17/h1-4,6-8,10,14,19,21,24-25H,5,9,11-13,15-16H2/t19-,21-,22+/m0/s1
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5.80E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DADLE from human delta opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50365108
PNG
(CHEMBL1951699)
Show SMILES CN1C[C@H](O)[C@@]2(CCC[C@H]1C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C15H21NO2/c1-16-10-14(18)15(7-3-5-12(16)9-15)11-4-2-6-13(17)8-11/h2,4,6,8,12,14,17-18H,3,5,7,9-10H2,1H3/t12-,14-,15+/m0/s1
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7.20E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DADLE from human delta opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50365113
PNG
(CHEMBL1951705)
Show SMILES CN1CC2(OCCO2)[C@@]2(CCC[C@H]1C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C17H23NO3/c1-18-12-17(20-8-9-21-17)16(7-3-5-14(18)11-16)13-4-2-6-15(19)10-13/h2,4,6,10,14,19H,3,5,7-9,11-12H2,1H3/t14-,16+/m0/s1
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>7.80E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DADLE from human delta opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50365110
PNG
(CHEMBL1951700)
Show SMILES CN1C[C@@H](O)[C@@]2(CCC[C@H]1C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C15H21NO2/c1-16-10-14(18)15(7-3-5-12(16)9-15)11-4-2-6-13(17)8-11/h2,4,6,8,12,14,17-18H,3,5,7,9-10H2,1H3/t12-,14+,15+/m0/s1
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8.30E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-U69593 from human kappa opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50365112
PNG
(CHEMBL1951704)
Show SMILES CN1C2C[C@](CCC2)([C@@H]1CO)c1cccc(O)c1 |r|
Show InChI InChI=1S/C15H21NO2/c1-16-12-5-3-7-15(9-12,14(16)10-17)11-4-2-6-13(18)8-11/h2,4,6,8,12,14,17-18H,3,5,7,9-10H2,1H3/t12?,14-,15-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DADLE from human delta opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50381677
PNG
(CHEMBL1256748 | U-69593)
Show SMILES CN([C@H]1C[C@@]2(CCCO2)CC[C@@H]1N1CCCC1)C(=O)Cc1ccccc1 |r|
Show InChI InChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)20-17-22(11-7-15-26-22)12-10-19(20)24-13-5-6-14-24/h2-4,8-9,19-20H,5-7,10-17H2,1H3/t19-,20-,22+/m0/s1
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1.25E+4n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DADLE from human delta opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50365110
PNG
(CHEMBL1951700)
Show SMILES CN1C[C@@H](O)[C@@]2(CCC[C@H]1C2)c1cccc(O)c1 |r|
Show InChI InChI=1S/C15H21NO2/c1-16-10-14(18)15(7-3-5-12(16)9-15)11-4-2-6-13(17)8-11/h2,4,6,8,12,14,17-18H,3,5,7,9-10H2,1H3/t12-,14+,15+/m0/s1
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>1.50E+4n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [3H]-DADLE from human delta opioid receptor expressed in CHO cells membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 50: 44-54 (2012)


Article DOI: 10.1016/j.ejmech.2012.01.025
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%